2-[4-[(5-nitro-1H-pyrrol-2-yl)carbonyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[(5-nitro-1H-pyrrol-2-yl)carbonyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(5-nitro-1H-pyrrole-2-carbonyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-[(5-nitro-1H-pyrrol-2-yl)-oxomethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(5-nitro-1H-pyrrole-2-carbonyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(5-nitro-1H-pyrrole-2-carbonyl)piperazino]acetic acid Formula: C11H14N4O5 MolecularWeight: 282.25266

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C(=O)C2=CC=C(N2)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC(=O)O)C(=O)C2=CC=C(N2)[N+](=O)[O-]

InChI

InChI=1S/C11H14N4O5/c16-10(17)7-13-3-5-14(6-4-13)11(18)8-1-2-9(12-8)15(19)20/h1-2,12H,3-7H2,(H,16,17)